2-chloranyl-5-[[6-[(4-ethoxycarbonylphenyl)methoxy]-2,3-dihydro-1H-inden-5-yl]diazenyl]benzenesulfonic acid

Systemtic Name: 2-chloranyl-5-[[6-[(4-ethoxycarbonylphenyl)methoxy]-2,3-dihydro-1H-inden-5-yl]diazenyl]benzenesulfonic acid Openeye Name: 2-chloro-5-[6-[(4-ethoxycarbonylphenyl)methoxy]indan-5-yl]azo-benzenesulfonic acid CAS Name: 2-chloro-5-[[6-[(4-ethoxycarbonylphenyl)methoxy]-2,3-dihydro-1H-inden-5-yl]azo]benzenesulfonic acid IUPAC Name: 2-chloro-5-[[6-[(4-ethoxycarbonylphenyl)methoxy]-2,3-dihydro-1H-inden-5-yl]diazenyl]benzenesulfonic acid Traditional Name: 5-[6-(4-carbethoxybenzyl)oxyindan-5-yl]azo-2-chloro-besylic acid Formula: C25H23ClN2O6S MolecularWeight: 514.97792

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)COC2=C(C=C3CCCC3=C2)N=NC4=CC(=C(C=C4)Cl)S(=O)(=O)O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)COC2=C(C=C3CCCC3=C2)N=NC4=CC(=C(C=C4)Cl)S(=O)(=O)O

InChI

InChI=1S/C25H23ClN2O6S/c1-2-33-25(29)17-8-6-16(7-9-17)15-34-23-13-19-5-3-4-18(19)12-22(23)28-27-20-10-11-21(26)24(14-20)35(30,31)32/h6-14H,2-5,15H2,1H3,(H,30,31,32)